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(1R,2R,7R,12R)-6-(R)-Hydroxy-7-hydroxy-7-methyl-9-oxa-tricyclo[6.3.1.0*1,5*]dodecan-10-one
SpectraBase Compound ID 9MhomlRRcqj
InChI InChI=1S/C12H18O4/c1-11(15)8-5-12(6-9(13)16-8)4-2-3-7(12)10(11)14/h7-8,10,14-15H,2-6H2,1H3/t7-,8+,10+,11-,12+/m0/s1
InChIKey ACJGBBRLULGZTD-YHPICNKRSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 478DKak3pA
Name (1R,2R,7R,12R)-6-(R)-Hydroxy-7-hydroxy-7-methyl-9-oxa-tricyclo[6.3.1.0*1,5*]dodecan-10-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-11(15)8-5-12(6-9(13)16-8)4-2-3-7(12)10(11)14/h7-8,10,14-15H,2-6H2,1H3/t7-,8+,10+,11-,12+/m0/s1
InChIKey ACJGBBRLULGZTD-YHPICNKRSA-N
Molecular Weight 226.272 g/mol
SMILES O[C@@]1([C@]2([C@]3(CC(O[C@@]([C@@]1(O)C)(C3)[H])=O)CCC2)[H])[H]
SPLASH splash10-0a59-9510000000-cdc1cb366832ca66a069
Source of Spectrum D1-1996-1164-14
Synonyms (1R,5R,6R,7R,8R)-6,7-dihydroxy-7-methyl-9-oxatricyclo[6.3.1.0(1,5)]dodecan-10-one 2-Oxo-9,10-dihydroxy-10-methyl-1-oxatricyclo[6.3.3.1.0]undecane
Wiley ID 834832